3-phenoxy-N-piperidin-4-ylbenzamide

C18H20N2O2 — CID 71730778

IUPAC3-phenoxy-N-piperidin-4-ylbenzamide
SMILESO=C(NC1CCNCC1)c1cccc(Oc2ccccc2)c1
InChIInChI=1S/C18H20N2O2/c21-18(20-15-9-11-19-12-10-15)14-5-4-8-17(13-14)22-16-6-2-1-3-7-16/h1-8,13,15,19H,9-12H2,(H,20,21)
InChIKeyRWHZRCLUHOCNSB-UHFFFAOYSA-N
MW296.37 g/mol
LogP2.96
Rot. Bonds4

About 3-phenoxy-N-piperidin-4-ylbenzamide

3-phenoxy-N-piperidin-4-ylbenzamide (PubChem CID 71730778) has the molecular formula C18H20N2O2 and a molecular weight of 296.37 g/mol. Its IUPAC name is 3-phenoxy-N-piperidin-4-ylbenzamide.

Molecular Properties

Compound Name3-phenoxy-N-piperidin-4-ylbenzamide
PubChem CID71730778
Molecular FormulaC18H20N2O2
Molecular Weight296.37 g/mol
Exact Mass296.15
IUPAC Name3-phenoxy-N-piperidin-4-ylbenzamide
SMILESO=C(NC1CCNCC1)c1cccc(Oc2ccccc2)c1
InChIInChI=1S/C18H20N2O2/c21-18(20-15-9-11-19-12-10-15)14-5-4-8-17(13-14)22-16-6-2-1-3-7-16/h1-8,13,15,19H,9-12H2,(H,20,21)
InChIKeyRWHZRCLUHOCNSB-UHFFFAOYSA-N
XLogP2.96
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-piperidin-4-yl-3-pyridin-4-yloxybenzamide;dihydrochloride
CID 119386172
N-cyclopentyl-3-phenoxybenzamide
CID 2684460
N-cyclopropyl-3-[(3-phenoxybenzoyl)amino]benzamide
CID 9438583
N-piperidin-4-yl-3-pyrazin-2-yloxybenzamide;dihydrochloride
CID 119388069
3-(3-methoxypropoxy)-N-piperidin-4-ylbenzamide
CID 119386846
N-[(4S)-azepan-4-yl]benzamide
CID 146196053
3-[(2-bromophenyl)methoxy]-N-piperidin-4-ylbenzamide;hydrochloride
CID 119385922
N-cyclopropyl-3-methoxybenzamide
CID 900156
(2S,4S)-5-oxo-4-[(3-phenoxybenzoyl)amino]pyrrolidine-2-carboxylic acid
CID 102273254
2,6-bis(4-cyanophenoxy)-N-piperidin-4-ylpyridine-4-carboxamide
CID 67607186
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-piperidin-4-ylbenzamide
CID 119388257
N-[(3S,4R)-3-hydroxyoxan-4-yl]-3-phenoxybenzamide
CID 91794686

Frequently Asked Questions

What is the IUPAC name of 3-phenoxy-N-piperidin-4-ylbenzamide?
The IUPAC name of 3-phenoxy-N-piperidin-4-ylbenzamide (CID 71730778) is 3-phenoxy-N-piperidin-4-ylbenzamide.
What is the SMILES notation for 3-phenoxy-N-piperidin-4-ylbenzamide?
The canonical SMILES for 3-phenoxy-N-piperidin-4-ylbenzamide is O=C(NC1CCNCC1)c1cccc(Oc2ccccc2)c1.
What is the InChIKey of 3-phenoxy-N-piperidin-4-ylbenzamide?
The InChIKey is RWHZRCLUHOCNSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O2/c21-18(20-15-9-11-19-12-10-15)14-5-4-8-17(13-14)22-16-6-2-1-3-7-16/h1-8,13,15,19H,9-12H2,(H,20,21).
What are the key properties of 3-phenoxy-N-piperidin-4-ylbenzamide?
3-phenoxy-N-piperidin-4-ylbenzamide has a molecular weight of 296.37 g/mol, XLogP of 2.96, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenoxy-N-piperidin-4-ylbenzamide is sourced from PubChem (CID 71730778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).